Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | item_count |
|
|
592904 | 2mw2 RC | 25296 | cing | 2-parsed | STAR | entry | full | 31 |
data_2mw2_MR_file_constraints
save_Conversion_project
_Study_list.Sf_category study_list
_Study_list.Entry_ID parsed_2mw2
_Study_list.ID 1
loop_
_Study.ID
_Study.Name
_Study.Type
_Study.Details
_Study.Entry_ID
_Study.Study_list_ID
1 "Conversion project" NMR . parsed_2mw2 1
stop_
save_
save_entry_information
_Entry.Sf_category entry_information
_Entry.ID parsed_2mw2
_Entry.Title "Original constraint list(s)"
_Entry.Version_type original
_Entry.Submission_date .
_Entry.Accession_date .
_Entry.Last_release_date .
_Entry.Original_release_date .
_Entry.Origination .
_Entry.NMR_STAR_version 3.1
_Entry.Original_NMR_STAR_version .
_Entry.Experimental_method NMR
_Entry.Experimental_method_subtype .
loop_
_Related_entries.Database_name
_Related_entries.Database_accession_code
_Related_entries.Relationship
_Related_entries.Entry_ID
PDB 2mw2 "Master copy" parsed_2mw2
stop_
save_
save_global_Org_file_characteristics
_Constraint_stat_list.Sf_category constraint_statistics
_Constraint_stat_list.Entry_ID parsed_2mw2
_Constraint_stat_list.ID 1
loop_
_Constraint_file.ID
_Constraint_file.Constraint_filename
_Constraint_file.Software_ID
_Constraint_file.Software_label
_Constraint_file.Software_name
_Constraint_file.Block_ID
_Constraint_file.Constraint_type
_Constraint_file.Constraint_subtype
_Constraint_file.Constraint_subsubtype
_Constraint_file.Constraint_number
_Constraint_file.Entry_ID
_Constraint_file.Constraint_stat_list_ID
1 2mw2.mr . . "MR format" 1 comment "Not applicable" "Not applicable" 0 parsed_2mw2 1
1 2mw2.mr . . XPLOR/CNS 2 distance "general distance" ambi 31 parsed_2mw2 1
1 2mw2.mr . . HADDOCK 3 distance NOE ambi 0 parsed_2mw2 1
1 2mw2.mr . . "MR format" 4 "nomenclature mapping" "Not applicable" "Not applicable" 0 parsed_2mw2 1
stop_
save_
save_MR_file_comment_1
_Org_constr_file_comment.Sf_category org_constr_file_comment
_Org_constr_file_comment.Entry_ID parsed_2mw2
_Org_constr_file_comment.ID 1
_Org_constr_file_comment.Constraint_file_ID 1
_Org_constr_file_comment.Block_ID 1
_Org_constr_file_comment.Details "Generated by Wattos"
_Org_constr_file_comment.Comment
;
*HEADER DNA BINDING PROTEIN 24-OCT-14 2MW2
*TITLE HHA-H-NS46 CHARGE ZIPPER COMPLEX
*COMPND MOL_ID: 1;
*COMPND 2 MOLECULE: HEMOLYSIN EXPRESSION-MODULATING PROTEIN HHA;
*COMPND 3 CHAIN: A;
*COMPND 4 FRAGMENT: RESIDUES 1-72;
*COMPND 5 ENGINEERED: YES;
*COMPND 6 MOL_ID: 2;
*COMPND 7 MOLECULE: DNA-BINDING PROTEIN H-NS;
*COMPND 8 CHAIN: B, C;
*COMPND 9 FRAGMENT: RESIDUES 1-46;
*COMPND 10 SYNONYM: HISTONE-LIKE PROTEIN HLP-II, PROTEIN B1, PROTEIN H1;
*COMPND 11 ENGINEERED: YES
*SOURCE MOL_ID: 1;
*SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12;
*SOURCE 3 ORGANISM_TAXID: 83333;
*SOURCE 4 STRAIN: K12;
*SOURCE 5 GENE: HHA, B0460, JW0449;
*SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET15B;
*SOURCE 9 MOL_ID: 2;
*SOURCE 10 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12;
*SOURCE 11 ORGANISM_TAXID: 83333;
*SOURCE 12 STRAIN: K12;
*SOURCE 13 GENE: HNS, BGLY, CUR, DRDX, HNSA, MSYA, OSMZ, PILG, TOPS, B1237,
*SOURCE 14 JW1225;
*SOURCE 15 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE 16 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE 17 EXPRESSION_SYSTEM_VECTOR: PET15B
*KEYWDS NUCLEOID-ASSOCIATED PROTEINS, CHARGE-ZIPPER COMPLEX, ELECTROSTATIC-
*KEYWDS 2 DRIVEN FUNCTION, SALT-DEPENDENT DYNAMICS, DNA BINDING PROTEIN
*EXPDTA SOLUTION NMR
*NUMMDL 10
*AUTHOR T.N.CORDEIRO, J.GARCIA, P.BERNADO, O.MILLET, M.PONS
*REVDAT 1 29-JUL-15 2MW2 0
;
save_
save_CNS/XPLOR_distance_constraints_2
_Distance_constraint_list.Sf_category distance_constraints
_Distance_constraint_list.Entry_ID parsed_2mw2
_Distance_constraint_list.ID 1
_Distance_constraint_list.Constraint_type "general distance"
_Distance_constraint_list.Constraint_file_ID 1
_Distance_constraint_list.Block_ID 2
_Distance_constraint_list.Details "Generated by Wattos"
loop_
_Dist_constraint_tree.Constraint_ID
_Dist_constraint_tree.Node_ID
_Dist_constraint_tree.Down_node_ID
_Dist_constraint_tree.Right_node_ID
_Dist_constraint_tree.Logic_operation
_Dist_constraint_tree.Entry_ID
_Dist_constraint_tree.Distance_constraint_list_ID
1 1 . . . parsed_2mw2 1
2 1 . . . parsed_2mw2 1
3 1 . . . parsed_2mw2 1
4 1 . . . parsed_2mw2 1
5 1 . . . parsed_2mw2 1
6 1 . . . parsed_2mw2 1
7 1 . . . parsed_2mw2 1
8 1 . . . parsed_2mw2 1
9 1 . . . parsed_2mw2 1
10 1 . . . parsed_2mw2 1
11 1 . . . parsed_2mw2 1
12 1 . . . parsed_2mw2 1
13 1 . . . parsed_2mw2 1
14 1 . . . parsed_2mw2 1
15 1 . . . parsed_2mw2 1
16 1 . . . parsed_2mw2 1
17 1 . . . parsed_2mw2 1
18 1 . . . parsed_2mw2 1
19 1 . . . parsed_2mw2 1
20 1 . . . parsed_2mw2 1
21 1 . . . parsed_2mw2 1
22 1 . . . parsed_2mw2 1
23 1 . . . parsed_2mw2 1
24 1 . . . parsed_2mw2 1
25 1 . . . parsed_2mw2 1
26 1 . . . parsed_2mw2 1
27 1 . . . parsed_2mw2 1
28 1 . . . parsed_2mw2 1
29 1 . . . parsed_2mw2 1
30 1 . . . parsed_2mw2 1
31 1 . . . parsed_2mw2 1
stop_
loop_
_Dist_constraint.Tree_node_member_constraint_ID
_Dist_constraint.Tree_node_member_node_ID
_Dist_constraint.Constraint_tree_node_member_ID
_Dist_constraint.Assembly_atom_ID
_Dist_constraint.Entity_assembly_ID
_Dist_constraint.Entity_ID
_Dist_constraint.Comp_index_ID
_Dist_constraint.Seq_ID
_Dist_constraint.Comp_ID
_Dist_constraint.Atom_ID
_Dist_constraint.Resonance_ID
_Dist_constraint.Auth_asym_ID
_Dist_constraint.Auth_seq_ID
_Dist_constraint.Auth_comp_ID
_Dist_constraint.Auth_atom_ID
_Dist_constraint.Entry_ID
_Dist_constraint.Distance_constraint_list_ID
1 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
1 1 2 . . . . . . . . B 32 . HN parsed_2mw2 1
1 1 2 . . . . . . . . C 32 . HN parsed_2mw2 1
2 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
2 1 2 . . . . . . . . B 35 . HN parsed_2mw2 1
2 1 2 . . . . . . . . C 35 . HN parsed_2mw2 1
3 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
3 1 2 . . . . . . . . B 36 . HN parsed_2mw2 1
3 1 2 . . . . . . . . C 36 . HN parsed_2mw2 1
4 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
4 1 2 . . . . . . . . B 38 . HN parsed_2mw2 1
4 1 2 . . . . . . . . C 38 . HN parsed_2mw2 1
5 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
5 1 2 . . . . . . . . B 38 . HD21 parsed_2mw2 1
5 1 2 . . . . . . . . C 38 . HD21 parsed_2mw2 1
6 1 1 . . . . . . . . A 66 . NAQ parsed_2mw2 1
6 1 2 . . . . . . . . B 39 . HN parsed_2mw2 1
6 1 2 . . . . . . . . C 39 . HN parsed_2mw2 1
7 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
7 1 2 . . . . . . . . B 2 . HN parsed_2mw2 1
7 1 2 . . . . . . . . C 2 . HN parsed_2mw2 1
8 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
8 1 2 . . . . . . . . B 6 . HN parsed_2mw2 1
8 1 2 . . . . . . . . C 6 . HN parsed_2mw2 1
9 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
9 1 2 . . . . . . . . B 7 . HN parsed_2mw2 1
9 1 2 . . . . . . . . C 7 . HN parsed_2mw2 1
10 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
10 1 2 . . . . . . . . B 8 . HN parsed_2mw2 1
10 1 2 . . . . . . . . C 8 . HN parsed_2mw2 1
11 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
11 1 2 . . . . . . . . B 9 . HN parsed_2mw2 1
11 1 2 . . . . . . . . C 9 . HN parsed_2mw2 1
12 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
12 1 2 . . . . . . . . B 13 . HN parsed_2mw2 1
12 1 2 . . . . . . . . C 13 . HN parsed_2mw2 1
13 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
13 1 2 . . . . . . . . B 14 . HN parsed_2mw2 1
13 1 2 . . . . . . . . C 14 . HN parsed_2mw2 1
14 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
14 1 2 . . . . . . . . B 15 . HN parsed_2mw2 1
14 1 2 . . . . . . . . C 15 . HN parsed_2mw2 1
15 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
15 1 2 . . . . . . . . B 16 . HN parsed_2mw2 1
15 1 2 . . . . . . . . C 16 . HN parsed_2mw2 1
16 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
16 1 2 . . . . . . . . B 17 . HN parsed_2mw2 1
16 1 2 . . . . . . . . C 17 . HN parsed_2mw2 1
17 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
17 1 2 . . . . . . . . C 18 . HN parsed_2mw2 1
17 1 2 . . . . . . . . C 81 . HN parsed_2mw2 1
18 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
18 1 2 . . . . . . . . B 19 . HN parsed_2mw2 1
18 1 2 . . . . . . . . C 19 . HN parsed_2mw2 1
19 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
19 1 2 . . . . . . . . C 20 . HN parsed_2mw2 1
19 1 2 . . . . . . . . C 83 . HN parsed_2mw2 1
20 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
20 1 2 . . . . . . . . B 21 . HN parsed_2mw2 1
20 1 2 . . . . . . . . C 21 . HN parsed_2mw2 1
21 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
21 1 2 . . . . . . . . B 22 . HN parsed_2mw2 1
21 1 2 . . . . . . . . C 22 . HN parsed_2mw2 1
22 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
22 1 2 . . . . . . . . B 23 . HN parsed_2mw2 1
22 1 2 . . . . . . . . C 23 . HN parsed_2mw2 1
23 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
23 1 2 . . . . . . . . B 24 . HN parsed_2mw2 1
23 1 2 . . . . . . . . C 24 . HN parsed_2mw2 1
24 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
24 1 2 . . . . . . . . B 25 . HN parsed_2mw2 1
24 1 2 . . . . . . . . C 25 . HN parsed_2mw2 1
25 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
25 1 2 . . . . . . . . B 26 . HN parsed_2mw2 1
25 1 2 . . . . . . . . C 26 . HN parsed_2mw2 1
26 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
26 1 2 . . . . . . . . B 28 . HN parsed_2mw2 1
26 1 2 . . . . . . . . C 28 . HN parsed_2mw2 1
27 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
27 1 2 . . . . . . . . B 29 . HN parsed_2mw2 1
27 1 2 . . . . . . . . C 29 . HN parsed_2mw2 1
28 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
28 1 2 . . . . . . . . C 30 . HN parsed_2mw2 1
28 1 2 . . . . . . . . C 93 . HN parsed_2mw2 1
29 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
29 1 2 . . . . . . . . B 33 . HN parsed_2mw2 1
29 1 2 . . . . . . . . C 33 . HN parsed_2mw2 1
30 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
30 1 2 . . . . . . . . B 34 . HN parsed_2mw2 1
30 1 2 . . . . . . . . C 34 . HN parsed_2mw2 1
31 1 1 . . . . . . . . A 37 . NAQ parsed_2mw2 1
31 1 2 . . . . . . . . B 35 . HN parsed_2mw2 1
31 1 2 . . . . . . . . C 35 . HN parsed_2mw2 1
stop_
loop_
_Dist_constraint_value.Constraint_ID
_Dist_constraint_value.Tree_node_ID
_Dist_constraint_value.Source_experiment_ID
_Dist_constraint_value.Spectral_peak_ID
_Dist_constraint_value.Intensity_val
_Dist_constraint_value.Intensity_lower_val_err
_Dist_constraint_value.Intensity_upper_val_err
_Dist_constraint_value.Distance_val
_Dist_constraint_value.Distance_lower_bound_val
_Dist_constraint_value.Distance_upper_bound_val
_Dist_constraint_value.Entry_ID
_Dist_constraint_value.Distance_constraint_list_ID
1 1 . . . . . 16.6 11.6 21.6 parsed_2mw2 1
2 1 . . . . . 15.6 10.6 20.6 parsed_2mw2 1
3 1 . . . . . 15.8 10.8 20.8 parsed_2mw2 1
4 1 . . . . . 16.3 11.3 21.3 parsed_2mw2 1
5 1 . . . . . 15.0 2.0 20.0 parsed_2mw2 1
6 1 . . . . . 15.4 10.4 20.4 parsed_2mw2 1
7 1 . . . . . 11.0 6.0 16.0 parsed_2mw2 1
8 1 . . . . . 10.5 5.5 15.5 parsed_2mw2 1
9 1 . . . . . 10.5 5.5 15.5 parsed_2mw2 1
10 1 . . . . . 10.3 5.3 15.3 parsed_2mw2 1
11 1 . . . . . 12.4 7.4 17.4 parsed_2mw2 1
12 1 . . . . . 11.7 6.7 16.7 parsed_2mw2 1
13 1 . . . . . 12.0 7.0 17.0 parsed_2mw2 1
14 1 . . . . . 15.5 10.5 20.5 parsed_2mw2 1
15 1 . . . . . 13.3 8.3 18.3 parsed_2mw2 1
16 1 . . . . . 12.4 7.4 17.4 parsed_2mw2 1
17 1 . . . . . 14.2 9.2 19.2 parsed_2mw2 1
18 1 . . . . . 13.6 8.6 18.6 parsed_2mw2 1
19 1 . . . . . 13.5 8.5 18.5 parsed_2mw2 1
20 1 . . . . . 13.0 8.0 18.0 parsed_2mw2 1
21 1 . . . . . 15.9 10.9 20.9 parsed_2mw2 1
22 1 . . . . . 15.0 10.0 20.0 parsed_2mw2 1
23 1 . . . . . 17.6 12.6 22.6 parsed_2mw2 1
24 1 . . . . . 14.7 9.7 19.7 parsed_2mw2 1
25 1 . . . . . 12.7 7.7 17.7 parsed_2mw2 1
26 1 . . . . . 13.1 8.1 18.1 parsed_2mw2 1
27 1 . . . . . 15.8 10.8 20.8 parsed_2mw2 1
28 1 . . . . . 15.4 10.4 20.4 parsed_2mw2 1
29 1 . . . . . 15.0 10.0 19.0 parsed_2mw2 1
30 1 . . . . . 14.6 9.6 19.6 parsed_2mw2 1
31 1 . . . . . 15.2 10.2 20.2 parsed_2mw2 1
stop_
loop_
_Dist_constraint_comment_org.ID
_Dist_constraint_comment_org.Comment_text
_Dist_constraint_comment_org.Comment_begin_line
_Dist_constraint_comment_org.Comment_begin_column
_Dist_constraint_comment_org.Comment_end_line
_Dist_constraint_comment_org.Comment_end_column
_Dist_constraint_comment_org.Entry_ID
_Dist_constraint_comment_org.Distance_constraint_list_ID
1
;
#########################################################################
# #
# The structure of the complex was calculated as follows: #
# PRE data, binding induced broadening and mutagenesis information #
# were converted into structural restraints and used in a flexible #
# Haddock docking protocol, starting with the known structures of #
# unbound Hha (PDB 1JW2) and H-NS46 antiparallel dimer (PDB 1NI8) #
# #
#########################################################################
(* all restrains are in CNS format *)
(* PREs Restraints originating from spin-labels attached to D37C or S66C in Hha *)
(* MTSL-tag at postion 66 *)
;
1 1 19 2 parsed_2mw2 1
2 "(* MTSL-tag at position 37 *)" 61 1 63 2 parsed_2mw2 1
stop_
save_